SCHEMBL3803312

SCHEMBL3803312

C#Cc1c(OC)c(-c2ccccc2)c2ccccc2c1-c1ccccc1

nearest known ligand 0.44

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
▸ PDE4B Q07343 6/20 0.44
▸ PDE4A P27815 5/20 0.44
▸ PDE4C Q08493 5/20 0.44
▸ PDE4D Q08499 5/20 0.44
▸ KDM4E B2RXH2 1/20 0.42
▸ ALDH1A1 P00352 1/20 0.42
▸ MAPK1 P28482 1/20 0.42
▸ SMN1; SMN2 Q16637 1/20 0.42
▸ CYP19A1 P11511 1/20 0.41
▸ POLB P06746 1/20 0.39
▸ ABCG2 Q9UNQ0 3/20 0.37
▸ ACHE P22303 1/20 0.34
▸ PDE9A O76083 1/20 0.33
▸ MPO P05164 1/20 0.33
▸ SQOR Q9Y6N5 1/20 0.33
▸ HDAC1 Q13547 1/20 0.33
▸ HDAC6 Q9UBN7 1/20 0.33
▸ ABCC1 P33527 1/20 0.33

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL13372165 0.77 KDM4E (0.58) PDE4BPDE4APDE4CPDE4DKDM4E
SCHEMBL28851984 0.75 CYP19A1 (0.50) KDM4EALDH1A1MAPK1CYP19A1ACHE
SCHEMBL20494555 0.72 CYP19A1 (0.47) KDM4EALDH1A1MAPK1CYP19A1ACHE
SCHEMBL3723473 0.72 KDM4E (0.56) PDE4BPDE4APDE4CPDE4DKDM4E
SCHEMBL28367468 0.70 FABP4 (0.40) PDE4BPDE4APDE4CPDE4DKDM4E
SCHEMBL12181771 0.70 PDE4B (0.71) PDE4BPDE4APDE4CPDE4DKDM4E
SCHEMBL29535843 0.68 ALDH1A1 (0.56) PDE4BPDE4APDE4CPDE4DKDM4E
SCHEMBL283173 0.68 ALDH1A1 (0.56) PDE4BPDE4APDE4CPDE4DKDM4E
SCHEMBL22126649 0.68 KDM4E (0.50) PDE4BPDE4APDE4CPDE4DKDM4E
SCHEMBL3430383 0.67 PDE4B (0.42) PDE4BPDE4APDE4CPDE4DKDM4E

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20100039684-A1 SENSITIZER DYES FOR PHOTOACID GENERATING SYSTEMS USING SHORT VISIBLE WAVELENGTHS FORCETEC CO., LTD. (KR) 2010-02-18 — — US disclosed
EP-2054770-A2 SENSITIZER DYES FOR PHOTOACID GENERATING SYSTEMS USING SHORT VISIBLE WAVELENGTHS STX Aprilis, Inc. (US) 2009-05-06 — — EP disclosed
WO-2008021208-A2 SENSITIZER DYES FOR PHOTOACID GENERATING SYSTEMS USING SHORT VISIBLE WAVELENGTHS STX APRILIS, INC. (US) 2008-02-21 — — WO disclosed
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